BDBM23027 1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]-7-(thiophen-2-yl)heptan-1-one::alpha-ketooxazole, 5a

SMILES O=C(CCCCCCc1cccs1)c1ncc(o1)-c1ccccn1

InChI Key InChIKey=VYGSYWKKZIMLJG-UHFFFAOYSA-N

Data  1 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 23027   

TargetCarboxylic ester hydrolase(Human)
The Scripps Research Institute

LigandPNGBDBM23027(1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]-7-(thiophen-2...)
Affinity DataIC50: 700nMT: 2°CAssay Description:The inhibition assays were performed by incubating enzyme, 14C-labeled oleamide in reaction buffer at room temperature in the presence of three diffe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/30/2008
Entry Details Article
PubMed
TargetDNA ligase 1(Human)
The Scripps Research Institute

LigandPNGBDBM23027(1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]-7-(thiophen-2...)
Affinity DataKi:  4.30nM ΔG°:  -11.3kcal/mole IC50: 20nMpH: 9.0 T: 2°CAssay Description:The inhibition assays were performed by incubating enzyme, 14C-labeled oleamide in reaction buffer at room temperature in the presence of three diffe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/30/2008
Entry Details Article
PubMed